CONDENSED AROMATICS .26. VIBRATIONAL FREQUENCIES OF C-13(60) ISOTOPIC BUCKMINSTERFULLERENE

被引：3

作者：

CYVIN, BN ^{[1
]}

BRENDSDAL, E ^{[1
]}

BRUNVOLL, J ^{[1
]}

CYVIN, SJ ^{[1
]}

机构：

[1] UNIV TRONDHEIM,DIV PHYS CHEM,N-7034 TRONDHEIM NTH,NORWAY

来源：

SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY | 1992年 / 48卷 / 10期

关键词：

D O I：

10.1016/0584-8539(92)80141-I

中图分类号：

O433 [光谱学];

学科分类号：

0703 ; 070302 ;

摘要：

The force-field of molecular vibrations of C60 buckminsterfullerene is refined and used to calculate the frequencies of C-13(60)isotopic buckminsterfullerene. The resulting IR-active frequencies show very good agreement with experimental data from literature. It is suggested that the predicted Raman-active frequencies for C-13(60) are reliable. Calculated Coriolis coupling constants for the IR-active frequencies are given.

引用

页码：1355 / 1361

页数：7

共 35 条

[1]

[Anonymous], 1955, MOL VIBRATIONS

[2] VIBRATIONAL RAMAN AND INFRARED-SPECTRA OF CHROMATOGRAPHICALLY SEPARATED C60 AND C70 FULLERENE CLUSTERS [J].

BETHUNE, DS ;

MEIJER, G ;

TANG, WC ;

ROSEN, HJ ;

GOLDEN, WG ;

SEKI, H ;

BROWN, CA ;

DEVRIES, MS .

CHEMICAL PHYSICS LETTERS, 1991, 179 (1-2) :181-186

[3]

Brendsdal, 1990, QUASICRYSTALS NETWOR

[4] SYMMETRY COORDINATES OF MOLECULAR VIBRATIONS OF FOOTBALLENE C-60 [J].

BRENDSDAL, E .

SPECTROSCOPY LETTERS, 1988, 21 (04) :319-339

[5] CONDENSED AROMATICS .22. NORMAL COORDINATE ANALYSIS OF FOOTBALLENE C-60 [J].

BRENDSDAL, E ;

CYVIN, BN ;

BRUNVOLL, J ;

CYVIN, SJ .

SPECTROSCOPY LETTERS, 1988, 21 (04) :313-318

[6] CONDENSED AROMATICS .24. CYCLO[D.E.D.E.E.D.E.D.E.E]DECAKISBENZENE [J].

BRENDSDAL, E ;

CYVIN, BN ;

BRUNVOLL, J ;

CYVIN, SJ .

SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 1988, 44 (10) :981-983

[7] CONDENSED AROMATICS .11. INPLANE VIBRATIONS OF POLYCENES [J].

BRUNVOLL, J ;

CYVIN, BN ;

CYVIN, SJ .

SPECTROSCOPY LETTERS, 1981, 14 (01) :27-36

[8] CALCULATIONS OF ELECTRONIC-PROPERTIES AND OF THE NORMAL VIBRATIONAL FREQUENCIES OF CARBON CLUSTERS HAVING REGULAR OR SEMI-REGULAR POLYHEDRAL STRUCTURES [J].

COULOMBEAU, C ;

RASSAT, A .

JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE, 1987, 84 (7-8) :875-882

[9] MOLECULAR VIBRATIONS OF HEXABENZOCORONENES [J].

CYVIN, BN ;

CYVIN, SJ .

SPECTROSCOPY LETTERS, 1986, 19 (10) :1161-1173

[10] CONDENSED AROMATICS .23. CYCLO[D.E.D.E.D.E.D.E.D.E.D.E]DODECAKISBENZENE (KEKULENE) [J].

CYVIN, SJ ;

BRUNVOLL, J ;

CYVIN, BN ;

BRENDSDAL, E .

SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 1988, 44 (10) :975-979

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